SCHEMBL4491806

SCHEMBL4491806

Fc1cc(N2CCc3c(Cl)ncnc32)ccc1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
HTT P42858 2/20 0.35
APP P05067 1/20 0.35
DGAT1 O75907 2/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LRRK2 Q5S007 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4492509 0.80 HTT (0.40) GPR119HTTAPPKDM4EMEN1
SCHEMBL4503148 0.80 HTT (0.36) GPR119HTTHTR2AHTR2CHTR2B
SCHEMBL4482969 0.77 GPR119 (0.39) GPR119EGFRHTT
SCHEMBL12170572 0.77 EIF4E (0.46) GPR119HTTLRRK2
SCHEMBL16532035 0.72 DGAT1 (0.59) DGAT1
SCHEMBL4483229 0.69 GPR119 (0.79) GPR119
SCHEMBL4497686 0.69 HTT (0.37) GPR119HTTAPPSMN1; SMN2HTR2A
SCHEMBL4479394 0.68 CYP1A2 (0.38) GPR119HTTAPPKDM4EMEN1
SCHEMBL4494380 0.68 ALDH1A1 (0.39) GPR119HTTALDH1A1LRRK2
SCHEMBL375962 0.68 GPR119 (0.61) GPR119

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222261-B2 Chemical compounds GlaxoSmithKline, LLC (US) 2012-07-17 US disclosed
US-20090318477-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2009-12-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090318477-A1 CHEMICAL COMPOUNDS GPR119, GOT2, SLC5A2 GPR119 1/4885EGFR 3991/4885ERBB2 2226/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.